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Keyword [first principles calculation]
Result: 101 - 120 | Page: 6 of 10
101.
Study On The Electronic Structure And The Lattice Dynamical Properties Of Ⅳ-Ⅵ Semiconductors
102.
Crystal Structures Design And Physical Properties Of Two-Dimensional Carbon-Based Spintronics And Dirac Materials
103.
Theoretical Exploration On High-temperature Quantum Anomalous Hall Effect
104.
Analysis And Simulation Calculation Study On Phase Transition And Hydrogen Defects In Ultrahigh-Pressure Minerals
105.
A Theoretical Investigation Of Two-dimensional Topological Insulators Based On Group Ⅳ Elements
106.
First-Principles Calculation On Photocatalytic Performance Of Doped Monoclinic BiVO
4
107.
First Principles Study On The Bcc And Fcc Structure Of Fe
1-x
T
x
（T=Cr,Mn,Co,Ni）Alloys
108.
First Principles Calculation On Electronic Structure And Optical Properties Of Anatase TiO
2
Doped Sixth Cycle Transition Elements
109.
First-principles Calculation Of Rare Earth Doped Black Phosphorus
110.
First Principles Calculation Of Magneto Mechanical Effect Of α-Fe
111.
The First-principles Study On The Magnetic Properties Of Transition Metal Doping Monolayer SnS
112.
First-principles Calculations On Magnetism Of β
12
Boron Sheet Nanoribbons
113.
First-principles Calculations On The Dynamic Properties Of Noble Metal Single-atom And Nanoclusters On WTe
2
Monolayer
114.
Electronic Properties And Mechanical Properties Of 2D TiS
3
:A First Principles Study
115.
The First Principles Calculation And Doping Modification Study On Electronic Structure Of P-Cu
2
O
116.
First-principles Study On Multiferroicity Of Organic Charge-transfer Complexes TTF-CA And TTF-QBrCl
3
117.
First-principles Investigation On Rashba Spin-Orbit Coupling In Two-Dimensional Transition Metal Dichalcogenide
118.
The Electronic And Magnetic Properties Of Two-dimension Materials With 3D Metal Trioxide And Tetraoxide Oxide Superhalogen Clunster-doped By First Principles Calculation
119.
First-principle Studies Of WO
3
As Anode Material For Lithium Ion Batteries
120.
Magnetic Properties And Magnetocaloric Effect Of The Cr-based Spinel Sulfides ACr
2
S
4
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